@MOLECULE hexanoyl (1R,2S)-2-methylcyclopropanecarboxylate 32 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C -4.3768 -0.2911 0.6615 C.3 1 UNL11111111 -0.0571 2 H -4.8523 -0.6806 1.5729 H 1 UNL11111111 0.2030 3 C -4.5408 1.1945 0.5180 C.3 1 UNL11111111 -0.8301 4 C -4.3577 -1.1714 -0.5611 C.3 1 UNL11111111 -0.4871 5 C -3.0789 -0.9836 0.2332 C.3 1 UNL11111111 -0.2893 6 H -2.7086 -1.8133 0.8516 H 1 UNL11111111 0.2375 7 C -2.0004 -0.1763 -0.3702 C.2 1 UNL11111111 0.4587 8 O -2.0480 0.6154 -1.2664 O.2 1 UNL11111111 -0.2844 9 O -0.7996 -0.5306 0.2078 O.3 1 UNL11111111 -0.4214 10 C 0.2936 0.3158 0.1929 C.2 1 UNL11111111 0.4322 11 O 0.1669 1.5019 0.1557 O.2 1 UNL11111111 -0.3283 12 C 1.5315 -0.5152 0.3154 C.3 1 UNL11111111 -0.3588 13 C 2.7707 0.3576 0.0984 C.3 1 UNL11111111 -0.3678 14 C 4.0418 -0.4976 0.1136 C.3 1 UNL11111111 -0.3979 15 C 5.2790 0.3749 -0.1396 C.3 1 UNL11111111 -0.0899 16 C 6.5581 -0.4580 -0.0636 C.3 1 UNL11111111 -0.8075 17 H -5.6004 1.4678 0.4236 H 1 UNL11111111 0.2652 18 H -4.1349 1.7309 1.3866 H 1 UNL11111111 0.2521 19 H -4.0290 1.5978 -0.3709 H 1 UNL11111111 0.2732 20 H -4.8509 -2.1395 -0.5529 H 1 UNL11111111 0.2156 21 H -4.4379 -0.7182 -1.5504 H 1 UNL11111111 0.2600 22 H 1.5579 -1.0038 1.3135 H 1 UNL11111111 0.2190 23 H 1.5020 -1.3523 -0.4162 H 1 UNL11111111 0.2060 24 H 2.6887 0.9045 -0.8628 H 1 UNL11111111 0.1950 25 H 2.8247 1.1449 0.8768 H 1 UNL11111111 0.1879 26 H 4.1413 -1.0212 1.0824 H 1 UNL11111111 0.1812 27 H 3.9803 -1.2908 -0.6551 H 1 UNL11111111 0.1884 28 H 5.2038 0.8608 -1.1316 H 1 UNL11111111 0.1264 29 H 5.3216 1.1985 0.5984 H 1 UNL11111111 0.1260 30 H 6.5517 -1.2724 -0.7963 H 1 UNL11111111 0.2313 31 H 7.4438 0.1555 -0.2639 H 1 UNL11111111 0.2265 32 H 6.6877 -0.9063 0.9276 H 1 UNL11111111 0.2344 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 1 5 1 7 5 7 1 8 7 8 2 9 7 9 1 10 9 10 1 11 10 11 2 12 10 12 1 13 12 13 1 14 13 14 1 15 14 15 1 16 15 16 1 17 3 17 1 18 3 18 1 19 3 19 1 20 4 20 1 21 4 21 1 22 12 22 1 23 12 23 1 24 13 24 1 25 13 25 1 26 14 26 1 27 14 27 1 28 15 28 1 29 15 29 1 30 16 30 1 31 16 31 1 32 16 32 1